2-[(3-nitrophenyl)methylsulfanyl]-6-oxidanylidene-4-phenyl-1H-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-[(3-nitrophenyl)methylsulfanyl]-6-oxidanylidene-4-phenyl-1H-pyridine-3,5-dicarbonitrile Openeye Name: 2-[(3-nitrophenyl)methylsulfanyl]-6-oxo-4-phenyl-1H-pyridine-3,5-dicarbonitrile CAS Name: 2-[(3-nitrophenyl)methylthio]-6-oxo-4-phenyl-1H-pyridine-3,5-dicarbonitrile IUPAC Name: 2-[(3-nitrophenyl)methylsulfanyl]-6-oxo-4-phenyl-1H-pyridine-3,5-dicarbonitrile Traditional Name: 2-keto-6-[(3-nitrobenzyl)thio]-4-phenyl-1H-pyridine-3,5-dicarbonitrile Formula: C20H12N4O3S MolecularWeight: 388.39928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)NC(=C2C#N)SCC3=CC(=CC=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)NC(=C2C#N)SCC3=CC(=CC=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C20H12N4O3S/c21-10-16-18(14-6-2-1-3-7-14)17(11-22)20(23-19(16)25)28-12-13-5-4-8-15(9-13)24(26)27/h1-9H,12H2,(H,23,25)